AG003I0H

69399-79-7 | 3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride

AG003I0H

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CAS Number	69399-79-7
Catalog Number	AG003I0H(AGN-PC-0KK7XA)
Chemical Name	3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride
EC Number	273-987-0
IUPAC Name	3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride
InChI	InChI=1S/C11H6Cl2FNO2/c1-5-8(11(13)16)10(15-17-5)9-6(12)3-2-4-7(9)14/h2-4H,1H3
InChI Key	XJCUKCOLGJDGGN-UHFFFAOYSA-N
MDL Number	MFCD00055650
Molecular Formula	C11H6Cl2FNO2
Molecular Weight	274.0752
SMILES	O=C(Cl)C1=C(C)ON=C1C2=C(F)C=CC=C2Cl
Synonyms	3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride, 69399-79-7, XJCUKCOLGJDGGN-UHFFFAOYSA-N, 3-(2-Chloro-6-fluoro-phenyl)-5-methyl-isoxazole-4-carbonyl chloride, W-104628, Fcimic chloride, 3-(2-chloro-6-fluorophenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride, 3-(2-chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarbonyl chloride, 3-(6-chloro-2-fluorophenyl)-5-methylisoxazole-4-carbonyl chloride, 3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYL ISOXAZOLE-4-CARBONYL CHLORIDE, 3-(2-Chloro-6-fluorophenyl)-5-methylisoxazole-4-carbonylchloride, EINECS 273-987-0, PubChem8771, AC1MC5WL, AC1Q2DHM, SCHEMBL1065677, CTK2F6436, DTXSID40219518, PC1886P, BCP19466, ZINC2169435, ZX-AP001678, ANW-44055, MFCD00055650, SBB053651, AKOS000121250, HCH0020282, MCULE-1961320582, RP29696, TRA0013949, SEL10401482, NCGC00253745-01, AC-10858, AJ-33976, AK-94164, AN-37934, AS-40172, BP-10349, CC-12262, K156, SC-62353, AX8022223, DB-021586, TC-132800, FT-0613537, ST24041394, 399C797, A836477, C-17258, SR-01000944787, I01-0994, SR-01000944787-1, 3-(2-chloro-6-fluorophenyl)-5-methylisoxaz-4-oyl chloride, 3-(2-Chloro-6-fluorophenyl)5-methylisoxaz-4-oyl chloride, 3-(2-chloro-6-fluorophenyl)-5-methyl-4-chlorocarbonylisoxazole, 3-(2-Chloro-6-fluorophenyl)-5-methylisoxazol-4-oyl chloride, 3-(2-CHLORO-6-FLUOROPHENYL)-5-METHYLISOXAZOLE-4-CA, 3-(2-chloro-6-fluoro-phenyl)-5-methylisoxazole-4-carbonyl chloride, 3-(2-chloro-6-fluorophenyl)-5-methylisoxazole4-carbonyl chloride, 3-(6-chloro-2-fluorophenyl)-5-methylisoxazole4-carbonyl chloride, 4-Isoxazolecarbonylchloride, 3-(2-chloro-6-fluorophenyl)-5-methyl-, 3-(2-Chloro-6-fluorophenyl)-5-methyl-4-isoxazolecarboxylic acid chloride, 4-Isoxazolecarbonyl chloride, 3-(2-chloro-6-fluorophenyl)-5-methyl-, 3-(2-chloranyl-6-fluoranyl-phenyl)-5-methyl-1,2-oxazole-4-carbonyl chloride, C11H6Cl2FNO2, cc-196, C11-H6-Cl2-F-N-O2, ZINC02169435, CID2736581,

Complexity	305
Compound Is Canonicalized	Yes
Covalently-Bonded Unit Count	1
Defined Atom Stereocenter Count	0
Defined Bond Stereocenter Count	0
Exact Mass	272.976g/mol
Formal Charge	0
Heavy Atom Count	17
Hydrogen Bond Acceptor Count	4
Hydrogen Bond Donor Count	0
Isotope Atom Count	0
Molecular Weight	274.072g/mol
Monoisotopic Mass	272.976g/mol
Rotatable Bond Count	2
Topological Polar Surface Area	43.1A^2
Undefined Atom Stereocenter Count	0
Undefined Bond Stereocenter Count	0
XLogP3	3.7

GHS Hazard and Precautionary Statements

Symbol:
Hazard Class	8
Hazard statements	H314-H318
Packing Group	Ⅱ
Precautionary statements	P260-P303+P361+P353-P305+P351+P338-P301+P330+P331-P405-P501
UN Code	UN 3261

Certificate of Analysis

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